SCHEMBL1662518

SCHEMBL1662518

O=C(O)N1CCC(c2nc(I)c(I)[nH]2)CC1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 9/20 0.39
PARP1 P09874 1/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
DGAT2 Q96PD7 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15555052 0.85 HTR2B (0.38) HTR2BPARP1USP2
SCHEMBL1568072 0.77 POLB (0.35)
SCHEMBL1664728 0.76 HTR2B (0.40) HTR2BPARP1LMNAL3MBTL1
SCHEMBL13505317 0.73 HCRTR1 (0.37)
SCHEMBL2511920 0.72 HTR2B (0.47) HTR2BUSP2LMNAL3MBTL1
SCHEMBL4121296 0.71 HTR2B (0.72) HTR2B
SCHEMBL7906028 0.70 HTR2B (0.51) HTR2BUSP2LMNA
SCHEMBL27766579 0.70 HTR2B (0.37) HTR2BPARP1USP2L3MBTL1
SCHEMBL18150661 0.69 HTR2B (0.34) HTR2BPARP1
SCHEMBL16992222 0.68 HTR2B (0.34) HTR2BPARP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2491032-B1 AKT INHIBITORS LILLY CO ELI (US) 2014-04-16 EP disclosed
US-8436002-B2 AKT inhibitors ELI LILLY AND COMPANY (US) 2013-05-07 US disclosed
EP-2491032-A1 AKT INHIBITORS Eli Lilly and Company (US) 2012-08-29 EP disclosed
US-20120149684-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2012-06-14 US disclosed
WO-2011050016-A1 AKT INHIBITORS ELI LILLY AND COMPANY (US) 2011-04-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120149684-A1 AKT INHIBITORS AKT2, PIK3CA, AKT3 HTR2B 3577/4885PARP1 1626/4885USP2 3432/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.